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Comparing Photosynthetic and Photovoltaic Efficiencies and Recognizing the Potential for Improvement

Science (American Association for the Advancement of Science), 2011-05, Vol.332 (6031), p.805-809

2011

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L-2-Hydroxyglutarate production arises from noncanonical enzyme function at acidic pH

Nature chemical biology, 2017-05, Vol.13 (5), p.494-500

2017

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Charge Transfer and Chemo-Mechanical Coupling in Respiratory Complex I

Journal of the American Chemical Society, 2020-05, Vol.142 (20), p.9220-9230

2020

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Comparison of proton transfer paths to the QA and QB sites of the Rb. sphaeroides photosynthetic reaction centers

Photosynthesis research, 2022-05, Vol.152 (2), p.153-165

2022

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Characterizing the proton loading site in cytochrome c oxidase

Proceedings of the National Academy of Sciences - PNAS, 2014-08, Vol.111 (34), p.12414-12419

2014

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Two Cl Ions and a Glu Compete for a Helix Cage in the CLC Proton/Cl− Antiporter

Biophysical journal, 2017-09, Vol.113 (5), p.1025-1036

2017

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The aprotic electrochemistry of quinones

Biochimica et biophysica acta. Bioenergetics, 2022-08, Vol.1863 (6), p.148558-148558, Article 148558

2022

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Characterizing Protein Protonation Microstates Using Monte Carlo Sampling

The journal of physical chemistry. B, 2022-04, Vol.126 (13), p.2476-2485

2022

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Tools for analyzing protonation states and for tracing proton transfer pathways with examples from the Rb. sphaeroides photosynthetic reaction centers

Photosynthesis research, 2023-04, Vol.156 (1), p.101-112

2023

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High-resolution cryo-electron microscopy structure of photosystem II from the mesophilic cyanobacterium, Synechocystis sp. PCC 6803

Proceedings of the National Academy of Sciences - PNAS, 2022-01, Vol.119 (1)

2022

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Photosystem II oxygen-evolving complex photoassembly displays an inverse H/D solvent isotope effect under chloride-limiting conditions

Proceedings of the National Academy of Sciences - PNAS, 2019-09, Vol.116 (38), p.18917-18922

2019

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Assignment of chlorophyll d in the ChlD1 site of the electron transfer chain of far-red light acclimated photosystem II supported by MCCE binding calculations

Biochimica et biophysica acta. Bioenergetics, 2024-11, Vol.1865 (4), p.149496, Article 149496

2024

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Proton exit pathways surrounding the oxygen evolving complex of photosystem II

Biochimica et biophysica acta. Bioenergetics, 2021-08, Vol.1862 (8), p.148446-148446, Article 148446

2021

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Proton-Coupled Electron Transfer During the S‑State Transitions of the Oxygen-Evolving Complex of Photosystem II

The journal of physical chemistry. B, 2015-06, Vol.119 (24), p.7366-7377

2015

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X‑ray Free Electron Laser Radiation Damage through the S‑State Cycle of the Oxygen-Evolving Complex of Photosystem II

The journal of physical chemistry. B, 2017-10, Vol.121 (40), p.9382-9388

2017

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Evaluation of log P, pK a , and log D predictions from the SAMPL7 blind challenge

Journal of computer-aided molecular design, 2021-07, Vol.35 (7), p.771

2021

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Hydrogen bond network analysis reveals the pathway for the proton transfer in the E-channel of T. thermophilus Complex I

Biochimica et biophysica acta. Bioenergetics, 2020-10, Vol.1861 (10), p.148240-148240, Article 148240

2020

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Network analysis of a proposed exit pathway for protons to the P-side of cytochrome c oxidase

Biochimica et biophysica acta. Bioenergetics, 2018-10, Vol.1859 (10), p.997-1005

2018

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Occupancy Analysis of Water Molecules inside Channels within 25 Å Radius of the Oxygen-Evolving Center of Photosystem II in Molecular Dynamics Simulations

The journal of physical chemistry. B, 2024-03, Vol.128 (10), p.2236-2248

2024

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Continuum Electrostatics Approaches to Calculating pKas and Ems in Proteins

Methods in enzymology, 2016-01, Vol.578, p.1-20

2016

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Halorhodopsin pumps Cl– and bacteriorhodopsin pumps protons by a common mechanism that uses conserved electrostatic interactions

Proceedings of the National Academy of Sciences - PNAS, 2014-11, Vol.111 (46), p.16377-16382

2014

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Identifying the proton loading site cluster in the ba3 cytochrome c oxidase that loads and traps protons

Biochimica et biophysica acta. Bioenergetics, 2020-10, Vol.1861 (10), p.148239-148239, Article 148239

2020

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Thermodynamics of the S2-to-S3 state transition of the oxygen-evolving complex of photosystem II

Physical chemistry chemical physics : PCCP, 2019, Vol.21 (37), p.20840-20848

2019

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Overview of the SAMPL6 pK a challenge: evaluating small molecule microscopic and macroscopic pK a predictions

Journal of computer-aided molecular design, 2021-02, Vol.35 (2), p.131

2021

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Changing hydration level in an internal cavity modulates the proton affinity of a key glutamate in cytochrome c oxidase

Proceedings of the National Academy of Sciences - PNAS, 2013-11, Vol.110 (47), p.18886-18891

2013

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Comparing Photosynthetic and Photovoltaic Efficiencies and Recognizing the Potential for Improvement

L-2-Hydroxyglutarate production arises from noncanonical enzyme function at acidic pH

Charge Transfer and Chemo-Mechanical Coupling in Respiratory Complex I

Comparison of proton transfer paths to the QA and QB sites of the Rb. sphaeroides photosynthetic reaction centers

Characterizing the proton loading site in cytochrome c oxidase

Two Cl Ions and a Glu Compete for a Helix Cage in the CLC Proton/Cl− Antiporter

The aprotic electrochemistry of quinones

Characterizing Protein Protonation Microstates Using Monte Carlo Sampling

Tools for analyzing protonation states and for tracing proton transfer pathways with examples from the Rb. sphaeroides photosynthetic reaction centers

High-resolution cryo-electron microscopy structure of photosystem II from the mesophilic cyanobacterium, Synechocystis sp. PCC 6803

Photosystem II oxygen-evolving complex photoassembly displays an inverse H/D solvent isotope effect under chloride-limiting conditions

Assignment of chlorophyll d in the ChlD1 site of the electron transfer chain of far-red light acclimated photosystem II supported by MCCE binding calculations

Proton exit pathways surrounding the oxygen evolving complex of photosystem II

Proton-Coupled Electron Transfer During the S‑State Transitions of the Oxygen-Evolving Complex of Photosystem II

X‑ray Free Electron Laser Radiation Damage through the S‑State Cycle of the Oxygen-Evolving Complex of Photosystem II

Evaluation of log P, pK a , and log D predictions from the SAMPL7 blind challenge

Hydrogen bond network analysis reveals the pathway for the proton transfer in the E-channel of T. thermophilus Complex I

Network analysis of a proposed exit pathway for protons to the P-side of cytochrome c oxidase

Occupancy Analysis of Water Molecules inside Channels within 25 Å Radius of the Oxygen-Evolving Center of Photosystem II in Molecular Dynamics Simulations

Continuum Electrostatics Approaches to Calculating pKas and Ems in Proteins

Halorhodopsin pumps Cl– and bacteriorhodopsin pumps protons by a common mechanism that uses conserved electrostatic interactions

Identifying the proton loading site cluster in the ba3 cytochrome c oxidase that loads and traps protons

Thermodynamics of the S2-to-S3 state transition of the oxygen-evolving complex of photosystem II

Overview of the SAMPL6 pK a challenge: evaluating small molecule microscopic and macroscopic pK a predictions

Changing hydration level in an internal cavity modulates the proton affinity of a key glutamate in cytochrome c oxidase

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